3-nitro-N-[(E)-[5-[(6-nitro-1,3-benzothiazol-2-yl)sulfanyl]furan-2-yl]methylideneamino]benzamide

Systemtic Name: 3-nitro-N-[(E)-[5-[(6-nitro-1,3-benzothiazol-2-yl)sulfanyl]furan-2-yl]methylideneamino]benzamide Openeye Name: 3-nitro-N-[(E)-[5-[(6-nitro-1,3-benzothiazol-2-yl)sulfanyl]-2-furyl]methyleneamino]benzamide CAS Name: 3-nitro-N-[(E)-[5-[(6-nitro-1,3-benzothiazol-2-yl)thio]-2-furanyl]methylideneamino]benzamide IUPAC Name: 3-nitro-N-[(E)-[5-[(6-nitro-1,3-benzothiazol-2-yl)sulfanyl]furan-2-yl]methylideneamino]benzamide Traditional Name: 3-nitro-N-[(E)-[5-[(6-nitro-1,3-benzothiazol-2-yl)thio]-2-furyl]methyleneamino]benzamide Formula: C19H11N5O6S2 MolecularWeight: 469.45054

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)NN=CC2=CC=C(O2)SC3=NC4=C(S3)C=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)N/N=C/C2=CC=C(O2)SC3=NC4=C(S3)C=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C19H11N5O6S2/c25-18(11-2-1-3-12(8-11)23(26)27)22-20-10-14-5-7-17(30-14)32-19-21-15-6-4-13(24(28)29)9-16(15)31-19/h1-10H,(H,22,25)/b20-10+